SCHEMBL3055485

SCHEMBL3055485

Cc1cc(S(=O)(=O)Nc2ccc3ccn(CCC(=O)NCCC4CCN(c5ccncc5)CC4)c3c2)c(C)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BDKRB1 P46663 8/20 0.38
▸ HTR6 P50406 5/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ F10 P00742 3/20 0.36
▸ MAPT P10636 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3065820 0.93 BDKRB1 (0.39) BDKRB1HTR6MEN1KMT2AF10
SCHEMBL3055517 0.86 BDKRB1 (0.39) BDKRB1MEN1KMT2AF10
SCHEMBL3056448 0.85 MTNR1A (0.41) BDKRB1HTR6MEN1KMT2AMAPK14
SCHEMBL3056437 0.80 BDKRB1 (0.40) BDKRB1MEN1KMT2AF10MAPT
SCHEMBL3047557 0.76 KMO (0.52) HTR6MEN1KMT2A
SCHEMBL4714168 0.75 BDKRB1 (0.48) BDKRB1MEN1KMT2AF10
SCHEMBL4711955 0.75 BDKRB1 (0.49) BDKRB1F10
SCHEMBL13139532 0.75 MEN1 (0.47) HTR6MEN1KMT2AMAPTTHRB
SCHEMBL3060515 0.74 BDKRB1 (0.48) BDKRB1MAPK14F10MAPTLMNA
SCHEMBL3049736 0.73 HTR6 (0.41) HTR6MEN1KMT2ALMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492559-B2 Substituted indole compounds GRUENENTHAL GMBH (DE) 2013-07-23 — — US claimed
US-20100222324-A1 Substituted Indole Compounds GRUENENTHAL GMBH (DE) 2010-09-02 — — US claimed
US-8492559-B2 Substituted indole compounds GRUENENTHAL GMBH (DE) 2013-07-23 — — US disclosed
US-20100222324-A1 Substituted Indole Compounds GRUENENTHAL GMBH (DE) 2010-09-02 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100222324-A1 Substituted Indole Compounds BDKRB1, BDKRB2, EDNRB BDKRB1 1/4885HTR6 103/4885MEN1 1256/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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